The LDA+DMFT route to identify good thermoelectrics

K. Held, R. Arita, V. I. Anisimov, K. Kuroki

Research output: Chapter in Book/Report/Conference proceedingConference contributionpeer-review

8 Citations (Scopus)

Abstract

For technical applications thermoelectric materials with a high figure of merit are desirable, and strongly correlated electron systems are very promising in this respect. Since effects of bandstructure and electronic correlations play an important role for getting large figure of merits, the combination of local density approximation and dynamical mean field theory is an ideal tool for the computational materials design of new thermoelectrics as well as to help us understand the mechanisms leading to large figures of merits in certain materials. This conference proceedings provides for a brief introduction to the method and reviews recent results for LiRh2O4.

Original languageEnglish
Title of host publicationProperties and Applications of Thermoelectric Materials
Subtitle of host publicationThe Search for New Materials for Thermoelectric Devices
EditorsVeljko Zlatic, Alex Hewson
Pages141-157
Number of pages17
DOIs
Publication statusPublished - 2009
Externally publishedYes

Publication series

NameNATO Science for Peace and Security Series B: Physics and Biophysics
ISSN (Print)1874-6500

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